N-[(4-fluoranyl-3-methyl-phenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-2-methyl-5-piperidinosulfonyl-benzamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=CC(=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=CC(=C(C=C3)F)C

InChI

InChI=1S/C21H25FN2O3S/c1-15-6-8-18(28(26,27)24-10-4-3-5-11-24)13-19(15)21(25)23-14-17-7-9-20(22)16(2)12-17/h6-9,12-13H,3-5,10-11,14H2,1-2H3,(H,23,25)